SCHEMBL7978249

SCHEMBL7978249

CN(C)C1CCC2NCCc3cccn3C2C1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7978386 0.79
SCHEMBL19005661 0.75 DRD2 (0.37) SIGMAR1
SCHEMBL19005642 0.62 SLC18A3 (0.35)
SCHEMBL10092844 0.62
SCHEMBL19005733 0.61 CHRNB4 (0.40)
SCHEMBL31505420 0.55
SCHEMBL24365456 0.55 SIGMAR1 (0.45) SIGMAR1
SCHEMBL29082372 0.55 SIGMAR1 (0.45) SIGMAR1
SCHEMBL1083195 0.54 ALDH1A1 (0.37)
SCHEMBL24696611 0.54 MAPK1 (0.41)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6225306-B1 PYRROLO(1,2A)QUINOXALINES WAKAMOTO PHARMACEUTICAL CO., LTD. (JP) 2001-05-01 US disclosed